Compound Identification
SMILES
COC1=CC=CC(NC(SCC2=C(F)C=CC(F)=C2)=C(C#N)C(=O)NCC2=CC=CC=C2)=C1
InChIKey
InChIKey=OADRBEKSYWKDHB-UHFFFAOYSA-N
Formula
C25H21F2N3O2S
Mass
465.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Aniline and substituted anilines
- Level 5 Methoxyanilines
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Subclass
Aniline and substituted anilines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Aniline and substituted anilines
Intermediate Tree Nodes
Not available
Direct Parent
Methoxyanilines
Alternative Parents
Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fluorobenzenes Vinylogous thioesters Aryl fluorides Vinylogous amides Secondary carboxylic acid amides Ketene acetals Sulfenyl compounds Nitriles Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Methoxyaniline - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Vinylogous thioester - Vinylogous amide - Carboxamide group - Secondary carboxylic acid amide - Ketene acetal or derivatives - Carboxylic acid derivative - Ether - Sulfenyl compound - Carbonitrile - Nitrile - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Cyanide - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as methoxyanilines. These are organic compound containing an aniline group substituted at one or more positions by a methoxy group.
External Descriptors
Not available